[2-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 3-methoxybenzoate

Systemtic Name: [2-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 3-methoxybenzoate Openeye Name: [2-[[4-(3-bromophenyl)thiazol-2-yl]amino]-2-oxo-ethyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [2-[[4-(3-bromophenyl)-2-thiazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [2-[[4-(3-bromophenyl)thiazol-2-yl]amino]-2-keto-ethyl] ester Formula: C19H15BrN2O4S MolecularWeight: 447.3024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H15BrN2O4S/c1-25-15-7-3-5-13(9-15)18(24)26-10-17(23)22-19-21-16(11-27-19)12-4-2-6-14(20)8-12/h2-9,11H,10H2,1H3,(H,21,22,23)